2-[[4-(2-carboxy-4-oxidanyl-phenyl)carbonyloxyphenyl]peroxymethyl]-5-oxidanyl-benzoic acid

Systemtic Name: 2-[[4-(2-carboxy-4-oxidanyl-phenyl)carbonyloxyphenyl]peroxymethyl]-5-oxidanyl-benzoic acid Openeye Name: 2-[[4-(2-carboxy-4-hydroxy-benzoyl)oxyphenyl]peroxymethyl]-5-hydroxy-benzoic acid CAS Name: 2-[[4-[(2-carboxy-4-hydroxyphenyl)-oxomethoxy]phenyl]dioxymethyl]-5-hydroxybenzoic acid IUPAC Name: 2-[[4-(2-carboxy-4-hydroxybenzoyl)oxyphenyl]peroxymethyl]-5-hydroxybenzoic acid Traditional Name: 2-[[4-(2-carboxy-4-hydroxy-benzoyl)oxyphenyl]peroxymethyl]-5-hydroxy-benzoic acid Formula: C22H16O10 MolecularWeight: 440.35644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(=O)C2=C(C=C(C=C2)O)C(=O)O)OOCC3=C(C=C(C=C3)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1OC(=O)C2=C(C=C(C=C2)O)C(=O)O)OOCC3=C(C=C(C=C3)O)C(=O)O

InChI

InChI=1S/C22H16O10/c23-13-2-1-12(18(9-13)20(25)26)11-30-32-16-6-4-15(5-7-16)31-22(29)17-8-3-14(24)10-19(17)21(27)28/h1-10,23-24H,11H2,(H,25,26)(H,27,28)